3-Butyl-2-[5-(1-butyl-3,3-dimethylindol-2(3H)-ylidene)pentane-1,3-dienyl]-1,1-dimethyl-1H-benzo[e]indolinium perchlorate
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![3-Butyl-2-[5-(1-butyl-3,3-dimethylindol-2(3H)-ylidene)pentane-1,3-dienyl]-1,1-dimethyl-1H-benzo[e]indolinium perchlorate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/9fdd54c24c4d4db8acc7836d403f3f17.png "3-Butyl-2-[5-(1-butyl-3,3-dimethylindol-2(3H)-ylidene)pentane-1,3-dienyl]-1,1-dimethyl-1H-benzo[e]indolinium perchlorate")
3-Butyl-2-[5-(1-butyl-3,3-dimethylindol-2(3H)-ylidene)pentane-1,3-dienyl]-1,1-dimethyl-1H-benzo[e]indolinium perchlorate
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CAS No:
173894-27-4
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Formula:
C36H43N2.ClO4
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Chemical Name:
3-Butyl-2-[5-(1-butyl-3,3-dimethylindol-2(3H)-ylidene)pentane-1,3-dienyl]-1,1-dimethyl-1H-benzo[e]indolinium perchlorate
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Synonyms:
CTK4D4795;DTXSID50724724;3-BUTYL-2-[5-(1,3-DIHYDRO-3,3-DIMETHYL-1-PROPYL-2H-INDOL-2-YLIDENE)-PENTA-1,3-DIENYL]-1,1-DIMETHYL-1H-BENZO[E]INDOLIUM PERCHLORATE;3-Butyl-2-[5-(3,3-dimethyl-1-propyl-1,3-dihydro-2H-indol-2-ylidene)penta-1,3-dien-1-yl]-1,1-dimethyl-1H-benzo[e]indol-3-ium perchlorate
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CAS No:
3-Butyl-2-[5-(1-butyl-3,3-dimethylindol-2(3H)-ylidene)pentane-1,3-dienyl]-1,1-dimethyl-1H-benzo[e]indolinium perchlorate Basic Attributes
603.2
602.291
DTXSID50724724
Safety Information
|Warning|H228 (100%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P264, P270, P280, P301+P312, P330, P370+P378, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:603.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:602.2911356
Monoisotopic Mass:602.2911356
Topological Polar Surface Area:80.5
Heavy Atom Count:43
Complexity:1040
Undefined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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3-Butyl-2-[5-(1-butyl-3,3-dimethylindol-2(3H)-ylidene)pentane-1,3-dienyl]-1,1-dimethyl-1H-benzo[e]indolinium perchlorate
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